==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS INHIBITOR 30-NOV-11 3UW5 . COMPND 2 MOLECULE: BACULOVIRAL IAP REPEAT-CONTAINING PROTEIN 7, BACU . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.MAURER,S.G.HYMOWITZ . 188 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10329.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 4 1 2 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 78 A G 0 0 101 0, 0.0 74,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-177.6 77.0 83.5 22.7 2 79 A P - 0 0 47 0, 0.0 47,-0.2 0, 0.0 48,-0.1 -0.363 360.0-132.5 -68.3 147.1 77.4 79.7 23.5 3 80 A A S S+ 0 0 58 46,-2.0 46,-0.2 1,-0.3 47,-0.1 0.874 106.1 23.3 -59.2 -40.0 74.6 77.3 22.6 4 81 A F > + 0 0 72 44,-2.9 3,-2.0 1,-0.1 -1,-0.3 -0.751 69.3 176.8-133.5 79.7 74.8 75.8 26.1 5 82 A P G > S+ 0 0 90 0, 0.0 3,-2.1 0, 0.0 4,-0.2 0.801 75.8 70.7 -59.1 -29.8 76.2 78.4 28.5 6 83 A G G 3 S+ 0 0 42 1,-0.3 3,-0.3 2,-0.1 6,-0.0 0.661 97.8 50.5 -60.7 -19.1 75.7 76.1 31.5 7 84 A M G < S+ 0 0 5 -3,-2.0 -1,-0.3 41,-0.2 41,-0.2 0.116 76.4 106.9-105.9 21.4 78.5 73.9 30.2 8 85 A G < + 0 0 35 -3,-2.1 2,-0.5 40,-0.1 -1,-0.2 0.742 58.4 89.1 -67.5 -24.5 81.0 76.8 29.8 9 86 A S > - 0 0 54 -3,-0.3 4,-2.2 -4,-0.2 5,-0.2 -0.656 69.5-150.6 -78.9 122.0 83.0 75.5 32.8 10 87 A E H > S+ 0 0 102 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.884 98.2 55.0 -57.3 -39.1 85.7 73.0 31.9 11 88 A E H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 107.3 48.6 -63.9 -41.1 85.3 71.4 35.3 12 89 A L H > S+ 0 0 32 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.913 112.0 50.0 -63.7 -41.5 81.6 70.8 34.8 13 90 A R H >< S+ 0 0 5 -4,-2.2 3,-0.5 1,-0.2 25,-0.5 0.932 109.9 50.6 -61.0 -44.0 82.3 69.4 31.4 14 91 A L H >< S+ 0 0 35 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.914 105.1 56.6 -61.6 -42.2 84.9 67.1 32.9 15 92 A A H >< S+ 0 0 6 -4,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.816 95.3 66.8 -58.5 -31.2 82.5 65.9 35.6 16 93 A S G X< S+ 0 0 25 -4,-1.3 3,-0.5 -3,-0.5 -1,-0.3 0.665 89.8 66.6 -65.6 -16.6 80.1 64.8 32.8 17 94 A F G X + 0 0 9 -3,-1.8 3,-1.9 -4,-0.4 -1,-0.3 0.187 61.7 111.8 -90.7 17.1 82.6 62.1 31.8 18 95 A Y G < S+ 0 0 64 -3,-1.4 -1,-0.2 1,-0.3 79,-0.2 0.821 89.6 35.3 -58.9 -29.4 82.2 60.1 35.0 19 96 A D G < S+ 0 0 33 -3,-0.5 -1,-0.3 21,-0.1 -2,-0.1 -0.030 84.1 144.8-113.5 25.6 80.6 57.3 32.9 20 97 A W < - 0 0 12 -3,-1.9 3,-0.5 1,-0.1 23,-0.1 -0.495 39.5-153.8 -64.9 129.7 82.7 57.7 29.8 21 98 A P S S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.477 84.8 52.7 -86.5 -2.4 83.2 54.3 28.2 22 99 A L > + 0 0 37 4,-0.2 4,-3.2 20,-0.1 3,-0.1 -0.210 60.3 141.5-127.0 41.7 86.5 55.2 26.3 23 100 A T T 4 S+ 0 0 82 -3,-0.5 -1,-0.1 1,-0.2 -6,-0.0 0.903 78.9 38.9 -57.0 -48.8 88.8 56.6 29.1 24 101 A A T 4 S+ 0 0 93 1,-0.2 -1,-0.2 -3,-0.1 36,-0.1 0.841 120.8 46.8 -68.2 -32.4 92.0 55.0 27.9 25 102 A E T 4 S+ 0 0 80 1,-0.3 35,-2.4 34,-0.1 -2,-0.2 0.861 130.3 11.7 -81.8 -41.3 91.2 55.5 24.2 26 103 A V S < S- 0 0 0 -4,-3.2 -1,-0.3 33,-0.2 -4,-0.2 -0.874 87.4-129.8-141.1 102.0 90.0 59.2 24.3 27 104 A P >> - 0 0 43 0, 0.0 4,-2.2 0, 0.0 3,-0.6 -0.300 2.0-141.4 -62.8 130.7 90.8 61.0 27.6 28 105 A P H 3> S+ 0 0 9 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.837 102.9 62.0 -50.9 -37.6 88.0 62.9 29.3 29 106 A E H 3> S+ 0 0 118 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.900 107.7 42.0 -58.4 -43.2 90.5 65.6 30.2 30 107 A L H <> S+ 0 0 80 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.885 114.0 51.9 -71.6 -41.0 91.2 66.3 26.5 31 108 A L H <>S+ 0 0 0 -4,-2.2 5,-2.3 2,-0.2 -2,-0.2 0.953 112.9 44.3 -58.6 -50.2 87.5 66.1 25.5 32 109 A A H ><5S+ 0 0 0 -4,-3.0 3,-1.7 1,-0.2 -2,-0.2 0.902 111.5 53.3 -63.4 -42.0 86.5 68.6 28.3 33 110 A A H 3<5S+ 0 0 27 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.858 104.8 56.8 -60.2 -35.4 89.4 70.9 27.4 34 111 A A T 3<5S- 0 0 0 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.310 127.2 -97.9 -81.7 7.6 88.2 70.9 23.8 35 112 A G T < 5S+ 0 0 0 -3,-1.7 13,-2.4 1,-0.3 2,-0.3 0.388 80.1 134.5 97.5 -0.5 84.7 72.2 24.8 36 113 A F E < -A 47 0A 0 -5,-2.3 2,-0.3 11,-0.2 -1,-0.3 -0.592 32.9-171.2 -92.9 141.3 83.0 68.8 24.8 37 114 A F E -A 46 0A 17 9,-2.5 9,-2.1 -2,-0.3 2,-0.4 -0.921 34.4-100.7-120.9 156.4 80.6 67.4 27.4 38 115 A H E -A 45 0A 14 -25,-0.5 2,-0.6 -2,-0.3 7,-0.2 -0.603 30.2-163.4 -80.5 126.9 79.2 63.8 27.5 39 116 A T - 0 0 38 5,-2.4 5,-0.3 -2,-0.4 3,-0.2 -0.916 60.1 -23.8-115.1 102.2 75.7 63.4 26.2 40 117 A G S S- 0 0 48 -2,-0.6 -21,-0.1 1,-0.2 -2,-0.0 -0.585 91.9 -66.5 96.1-161.8 74.2 60.0 27.4 41 118 A H S S+ 0 0 143 -2,-0.2 -1,-0.2 -21,-0.1 -3,-0.0 0.577 109.9 67.3-105.3 -15.5 76.0 56.9 28.4 42 119 A Q S S- 0 0 128 -3,-0.2 -20,-0.1 -22,-0.1 -3,-0.1 0.233 110.2 -70.0 -85.5-148.7 77.6 55.8 25.1 43 120 A D S S+ 0 0 31 -23,-0.1 2,-0.3 -22,-0.1 14,-0.2 0.106 85.5 126.6-100.9 26.1 80.4 57.8 23.3 44 121 A K + 0 0 74 -5,-0.3 -5,-2.4 11,-0.1 2,-0.3 -0.628 30.7 172.2 -85.0 136.9 78.4 60.8 22.2 45 122 A V E -AB 38 54A 1 9,-2.2 9,-2.4 -2,-0.3 2,-0.3 -0.955 15.2-157.3-135.4 159.4 79.6 64.3 23.1 46 123 A R E -AB 37 53A 90 -9,-2.1 -9,-2.5 -2,-0.3 2,-0.4 -0.985 23.8-116.8-132.1 148.9 78.6 67.9 22.2 47 124 A C E > -A 36 0A 0 5,-1.9 4,-1.4 -2,-0.3 -11,-0.2 -0.673 18.9-141.0 -77.9 134.5 80.5 71.2 22.3 48 125 A F T 4 S+ 0 0 13 -13,-2.4 -44,-2.9 -2,-0.4 -45,-0.2 0.770 97.9 42.0 -66.0 -25.5 79.0 73.7 24.8 49 126 A F T 4 S+ 0 0 54 -14,-0.2 -46,-2.0 -47,-0.2 -1,-0.1 0.945 129.9 18.2 -90.5 -56.5 79.5 76.5 22.3 50 127 A C T 4 S- 0 0 47 -48,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.572 91.0-133.2 -92.3 -10.9 78.6 75.4 18.8 51 128 A Y < + 0 0 107 -4,-1.4 2,-0.1 1,-0.2 -3,-0.1 0.569 45.8 163.5 65.8 13.9 76.5 72.3 20.0 52 129 A G - 0 0 8 -6,-0.1 -5,-1.9 19,-0.1 2,-0.5 -0.428 28.0-144.0 -63.9 131.4 78.3 70.2 17.4 53 130 A G E -B 46 0A 21 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.2 -0.879 16.9-172.9-106.7 130.3 77.8 66.5 18.3 54 131 A L E +B 45 0A 2 -9,-2.4 -9,-2.2 -2,-0.5 2,-0.2 -0.967 11.5 157.9-123.8 138.6 80.5 63.8 17.7 55 132 A Q B +C 186 0B 64 131,-2.7 131,-2.6 -2,-0.4 -11,-0.1 -0.740 46.6 61.1-138.6-174.9 80.2 60.1 18.1 56 133 A S - 0 0 47 -2,-0.2 2,-0.2 129,-0.2 -1,-0.1 0.903 69.3-167.2 55.5 47.4 82.0 56.9 16.9 57 134 A W - 0 0 12 -14,-0.2 2,-0.3 128,-0.1 -1,-0.2 -0.450 6.6-149.0 -68.3 133.7 85.3 57.9 18.5 58 135 A K > - 0 0 139 -2,-0.2 3,-2.1 1,-0.1 -1,-0.0 -0.767 34.0 -85.4-101.6 151.1 88.3 55.8 17.5 59 136 A R T 3 S+ 0 0 218 -2,-0.3 -33,-0.2 1,-0.3 3,-0.1 -0.277 115.6 17.7 -56.8 135.0 91.2 55.2 19.8 60 137 A G T 3 S+ 0 0 68 -35,-2.4 -1,-0.3 1,-0.3 -34,-0.1 0.453 83.8 152.4 80.3 0.7 93.7 58.0 19.7 61 138 A D < - 0 0 28 -3,-2.1 -1,-0.3 -36,-0.2 -4,-0.0 -0.414 43.3-132.6 -57.6 139.4 91.3 60.5 18.1 62 139 A D > - 0 0 60 1,-0.1 4,-2.6 -3,-0.1 5,-0.3 -0.881 6.0-148.0-101.8 115.8 92.3 64.0 19.2 63 140 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.1 0.874 96.8 47.6 -51.6 -45.5 89.4 66.1 20.5 64 141 A W H > S+ 0 0 39 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.914 112.5 49.6 -62.4 -43.6 90.7 69.4 19.2 65 142 A T H > S+ 0 0 48 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.916 112.7 46.8 -59.9 -45.9 91.5 68.0 15.8 66 143 A E H X S+ 0 0 15 -4,-2.6 4,-2.3 2,-0.2 5,-0.4 0.885 110.1 54.3 -63.5 -39.3 88.1 66.5 15.5 67 144 A H H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.927 113.6 41.6 -58.5 -46.7 86.5 69.8 16.7 68 145 A A H < S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.822 113.1 53.9 -72.9 -33.9 88.4 71.7 13.9 69 146 A K H < S+ 0 0 100 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.927 123.6 23.4 -63.5 -46.9 87.7 69.0 11.3 70 147 A W H < S+ 0 0 91 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.774 134.0 30.1 -97.3 -31.5 83.9 69.0 11.7 71 148 A F >< + 0 0 38 -4,-2.3 3,-2.0 -5,-0.4 -1,-0.2 -0.423 63.2 156.8-129.4 59.5 83.0 72.3 13.2 72 149 A P T 3 S+ 0 0 50 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.649 71.1 60.9 -63.8 -16.2 85.6 74.8 11.9 73 150 A G T 3 S+ 0 0 59 -3,-0.1 2,-0.2 4,-0.1 -5,-0.1 0.415 72.2 125.2 -89.5 0.1 83.3 77.8 12.4 74 151 A C <> - 0 0 6 -3,-2.0 4,-2.2 -7,-0.2 5,-0.1 -0.426 52.6-151.8 -64.8 128.3 83.0 77.3 16.2 75 152 A Q H > S+ 0 0 107 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.790 95.3 55.3 -76.1 -29.2 84.0 80.5 18.0 76 153 A F H > S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.917 109.6 48.3 -62.7 -46.3 85.2 78.7 21.1 77 154 A L H >>S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.6 0.940 113.7 47.1 -55.2 -50.9 87.5 76.7 18.9 78 155 A L H X5S+ 0 0 49 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.944 114.0 45.9 -58.6 -51.0 88.8 79.8 17.2 79 156 A R H <5S+ 0 0 231 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.852 120.4 40.7 -60.6 -37.1 89.3 81.7 20.5 80 157 A S H <5S+ 0 0 58 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.899 132.2 17.2 -79.2 -45.8 91.1 78.7 22.1 81 158 A K H X5S- 0 0 83 -4,-3.1 4,-0.5 -5,-0.2 -3,-0.2 0.598 98.8-128.9-110.7 -18.6 93.2 77.4 19.2 82 159 A G H X< - 0 0 27 -4,-2.3 4,-1.4 -5,-0.6 5,-0.1 0.122 28.5 -80.0 84.7 162.0 93.4 80.2 16.6 83 160 A Q H > S+ 0 0 93 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.832 122.5 59.9 -70.9 -34.8 92.8 80.4 12.9 84 161 A E H > S+ 0 0 159 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.930 105.0 50.2 -60.3 -46.0 96.1 78.9 11.8 85 162 A Y H X S+ 0 0 55 -4,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.920 113.2 45.8 -55.1 -47.9 95.4 75.7 13.7 86 163 A I H X S+ 0 0 3 -4,-1.4 4,-1.6 1,-0.2 3,-0.3 0.927 113.0 49.9 -64.1 -46.2 92.0 75.4 12.1 87 164 A N H < S+ 0 0 95 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.875 107.3 54.4 -59.8 -40.6 93.3 76.2 8.6 88 165 A N H < S+ 0 0 137 -4,-2.5 -1,-0.2 2,-0.3 -2,-0.2 0.824 106.0 51.4 -67.7 -31.9 96.1 73.6 8.9 89 166 A I H < 0 0 55 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.844 360.0 360.0 -71.1 -34.4 93.6 70.8 9.8 90 167 A H < 0 0 141 -4,-1.6 -2,-0.3 -5,-0.1 -3,-0.2 0.722 360.0 360.0 -93.6 360.0 91.7 71.8 6.7 91 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 92 78 B G 0 0 110 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 179.6 88.5 48.5 42.3 93 79 B P - 0 0 60 0, 0.0 47,-0.2 0, 0.0 48,-0.2 -0.399 360.0-143.5 -61.8 133.0 87.1 52.1 42.5 94 80 B A S S+ 0 0 39 46,-1.9 46,-0.2 1,-0.3 45,-0.1 0.885 93.0 17.5 -65.1 -43.0 83.8 52.3 40.7 95 81 B F S > S- 0 0 24 44,-3.3 3,-1.5 1,-0.1 -1,-0.3 -0.724 71.3-178.7-133.2 78.3 84.3 55.9 39.4 96 82 B P G > S+ 0 0 91 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.826 80.0 56.6 -53.8 -40.3 88.1 56.6 39.5 97 83 B G G > S+ 0 0 53 1,-0.3 3,-1.3 -79,-0.2 6,-0.2 0.806 97.4 64.2 -62.1 -28.6 87.9 60.1 38.1 98 84 B M G < S+ 0 0 1 -3,-1.5 -1,-0.3 1,-0.3 41,-0.2 0.331 72.0 94.8 -82.3 9.4 85.4 61.0 40.9 99 85 B G G < + 0 0 37 -3,-1.8 2,-0.6 40,-0.1 -1,-0.3 0.701 66.4 90.9 -63.6 -21.9 88.2 60.4 43.4 100 86 B S S <> S- 0 0 56 -3,-1.3 4,-2.2 1,-0.2 5,-0.2 -0.699 71.0-154.2 -76.1 118.4 88.8 64.2 43.1 101 87 B E H > S+ 0 0 92 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.879 95.8 56.3 -61.0 -37.0 86.6 66.0 45.7 102 88 B E H > S+ 0 0 128 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.900 108.1 47.2 -61.4 -41.2 86.5 69.1 43.5 103 89 B L H > S+ 0 0 14 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.885 110.7 52.0 -69.8 -37.6 85.1 67.0 40.6 104 90 B R H < S+ 0 0 8 -4,-2.2 25,-0.5 2,-0.2 4,-0.4 0.941 110.5 48.2 -59.5 -46.2 82.5 65.4 43.0 105 91 B L H >< S+ 0 0 67 -4,-2.8 3,-1.7 1,-0.2 -2,-0.2 0.912 107.0 57.2 -61.1 -40.6 81.5 68.9 44.1 106 92 B A H >< S+ 0 0 14 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.846 94.7 66.1 -58.1 -35.8 81.3 70.0 40.4 107 93 B S G >< S+ 0 0 6 -4,-1.6 3,-0.6 -3,-0.3 -1,-0.3 0.685 90.3 66.6 -60.0 -19.3 78.7 67.2 39.8 108 94 B F G X + 0 0 12 -3,-1.7 3,-1.7 -4,-0.4 -1,-0.3 0.249 63.4 108.2 -88.6 13.3 76.3 69.0 42.1 109 95 B Y G < S+ 0 0 118 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.811 90.9 35.2 -56.3 -30.1 75.9 72.0 39.7 110 96 B D G < S+ 0 0 35 -3,-0.6 -1,-0.3 -4,-0.1 -2,-0.1 -0.046 82.2 147.5-117.7 27.9 72.4 70.6 39.0 111 97 B W < - 0 0 23 -3,-1.7 23,-0.1 1,-0.1 22,-0.1 -0.419 62.1 -95.7 -57.9 133.7 71.5 69.4 42.5 112 98 B P > - 0 0 26 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.304 21.0-136.5 -61.3 140.5 67.8 69.8 42.9 113 99 B L T 3 S+ 0 0 178 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.638 105.8 60.1 -69.8 -13.0 66.8 73.0 44.7 114 100 B T T 3 S+ 0 0 119 2,-0.0 -1,-0.3 0, 0.0 20,-0.0 0.534 80.0 118.8 -86.1 -10.5 64.3 70.9 46.7 115 101 B A < - 0 0 23 -3,-1.6 34,-0.1 1,-0.1 -4,-0.0 -0.189 55.4-150.8 -61.9 151.7 67.1 68.7 48.1 116 102 B E S S+ 0 0 101 32,-0.4 35,-0.5 1,-0.1 -1,-0.1 0.426 74.2 59.7-108.6 -3.0 67.6 68.7 51.9 117 103 B V S S- 0 0 6 33,-0.1 31,-0.1 31,-0.1 -1,-0.1 -0.992 85.9-114.1-129.9 135.9 71.3 68.0 52.3 118 104 B P >> - 0 0 66 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.400 13.6-125.6 -79.1 147.5 74.0 70.3 50.9 119 105 B P H 3> S+ 0 0 37 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.845 106.2 61.8 -48.1 -43.3 76.5 69.3 48.1 120 106 B E H 3> S+ 0 0 104 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.897 107.2 42.8 -58.6 -42.9 79.5 70.3 50.2 121 107 B L H <> S+ 0 0 78 -3,-0.6 4,-1.1 2,-0.2 -1,-0.2 0.889 115.1 49.9 -70.2 -39.6 78.8 67.6 52.8 122 108 B L H ><>S+ 0 0 0 -4,-1.7 5,-2.0 2,-0.2 3,-0.8 0.951 110.9 48.0 -63.9 -49.4 77.9 65.0 50.3 123 109 B A H ><5S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.3 -1,-0.2 0.873 107.4 57.3 -59.8 -39.2 81.0 65.5 48.2 124 110 B A H 3<5S+ 0 0 28 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.799 103.6 54.0 -61.3 -30.1 83.2 65.4 51.4 125 111 B A T <<5S- 0 0 0 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.197 128.3 -94.5 -94.4 16.8 81.8 61.9 52.2 126 112 B G T < 5S+ 0 0 0 -3,-1.6 13,-2.4 1,-0.3 2,-0.3 0.418 82.9 132.0 93.9 -0.1 82.7 60.5 48.8 127 113 B F E < -D 138 0C 0 -5,-2.0 2,-0.3 11,-0.2 -1,-0.3 -0.623 31.7-174.9 -93.2 143.2 79.4 61.0 47.0 128 114 B F E -D 137 0C 0 9,-2.4 9,-2.3 -2,-0.3 2,-0.3 -0.951 29.9-104.8-130.4 156.0 78.8 62.6 43.6 129 115 B H E -D 136 0C 6 -25,-0.5 2,-0.3 -2,-0.3 7,-0.2 -0.606 31.0-174.7 -85.2 131.7 75.5 63.4 41.9 130 116 B T - 0 0 21 5,-1.7 5,-0.4 -2,-0.3 3,-0.3 -0.910 54.2 -9.6-116.0 152.7 74.1 61.4 39.0 131 117 B G S S- 0 0 43 -2,-0.3 -21,-0.1 1,-0.2 -2,-0.0 -0.200 94.3 -70.2 64.3-149.7 70.9 62.3 37.1 132 118 B H S S+ 0 0 139 -21,-0.1 -1,-0.2 -20,-0.0 2,-0.1 0.442 105.1 69.9-132.5 -1.2 68.6 65.0 38.1 133 119 B Q S S- 0 0 122 -3,-0.3 -18,-0.1 -22,-0.1 -23,-0.0 -0.000 110.1 -72.5 -89.8-152.2 66.8 64.0 41.2 134 120 B D S S+ 0 0 25 -23,-0.1 2,-0.3 -2,-0.1 14,-0.2 0.001 83.0 139.2 -99.9 34.5 68.7 63.8 44.5 135 121 B K + 0 0 85 -5,-0.4 -5,-1.7 11,-0.1 2,-0.3 -0.537 24.5 176.0 -78.1 135.2 70.6 60.6 43.7 136 122 B V E -DE 129 145C 1 9,-2.4 9,-2.3 -2,-0.3 2,-0.3 -0.955 12.9-158.8-130.5 156.4 74.3 60.2 44.6 137 123 B R E -DE 128 144C 71 -9,-2.3 -9,-2.4 -2,-0.3 2,-0.4 -0.974 26.3-114.0-126.7 148.1 76.8 57.4 44.3 138 124 B C E > -D 127 0C 0 5,-1.8 4,-1.6 -2,-0.3 -11,-0.2 -0.678 21.3-138.2 -74.3 132.6 80.1 56.8 46.1 139 125 B F T 4 S+ 0 0 18 -13,-2.4 -44,-3.3 -2,-0.4 -41,-0.2 0.772 98.8 37.2 -61.9 -27.4 83.0 57.1 43.7 140 126 B F T 4 S+ 0 0 42 -14,-0.2 -46,-1.9 -47,-0.2 -1,-0.1 0.937 127.6 24.3 -92.4 -57.7 84.7 54.1 45.3 141 127 B C T 4 S- 0 0 45 -48,-0.2 -2,-0.1 2,-0.1 3,-0.1 0.516 90.9-128.4 -92.8 -5.0 82.0 51.5 46.3 142 128 B Y < + 0 0 117 -4,-1.6 -3,-0.1 1,-0.2 -1,-0.1 0.207 50.2 160.2 77.9 -11.5 79.3 52.5 43.8 143 129 B G - 0 0 8 -6,-0.2 -5,-1.8 1,-0.1 2,-0.4 -0.140 26.2-151.7 -53.0 126.8 76.7 52.7 46.6 144 130 B G E +E 137 0C 19 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.836 17.0 176.6-107.4 138.4 73.7 54.8 45.6 145 131 B L E +E 136 0C 3 -9,-2.3 -9,-2.4 -2,-0.4 2,-0.2 -0.993 4.4 162.6-139.2 145.1 71.5 56.9 47.9 146 132 B Q B +F 190 0D 56 44,-2.5 44,-2.7 -2,-0.3 -11,-0.1 -0.799 48.7 63.1-143.5-174.1 68.5 59.2 47.3 147 133 B S - 0 0 37 -2,-0.2 2,-0.2 42,-0.2 -1,-0.1 0.928 67.5-166.0 53.9 50.6 65.6 60.8 49.2 148 134 B W - 0 0 5 -14,-0.2 -32,-0.4 41,-0.1 2,-0.3 -0.477 3.7-150.4 -67.0 132.1 67.9 62.7 51.5 149 135 B K > - 0 0 127 -2,-0.2 3,-2.3 1,-0.1 -1,-0.0 -0.721 29.7 -82.2-106.1 157.0 66.1 64.1 54.5 150 136 B R T 3 S+ 0 0 202 -2,-0.3 -33,-0.1 1,-0.3 3,-0.1 -0.325 118.7 19.5 -54.8 131.5 66.8 67.2 56.6 151 137 B G T 3 S+ 0 0 79 -35,-0.5 -1,-0.3 1,-0.3 2,-0.1 0.378 84.7 145.8 84.5 -4.4 69.6 66.4 59.1 152 138 B D < - 0 0 30 -3,-2.3 -1,-0.3 -36,-0.1 3,-0.1 -0.472 42.8-142.5 -61.2 135.5 70.8 63.3 57.3 153 139 B D > - 0 0 66 1,-0.1 4,-2.5 -2,-0.1 3,-0.3 -0.920 1.2-147.0-104.5 114.8 74.6 63.1 57.8 154 140 B P H > S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.858 97.8 48.4 -50.8 -43.6 76.4 61.8 54.6 155 141 B W H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.910 112.0 49.6 -62.8 -42.9 79.1 60.0 56.5 156 142 B T H > S+ 0 0 47 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.925 112.7 46.8 -60.9 -44.9 76.6 58.3 58.7 157 143 B E H X S+ 0 0 18 -4,-2.5 4,-2.5 2,-0.2 5,-0.4 0.880 108.9 55.4 -66.1 -38.7 74.5 57.2 55.8 158 144 B H H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.930 113.3 42.0 -55.9 -47.1 77.6 56.0 53.9 159 145 B A H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.869 113.2 53.0 -70.7 -39.3 78.4 53.8 56.9 160 146 B K H < S+ 0 0 106 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.949 123.2 25.5 -59.0 -51.0 74.8 52.6 57.5 161 147 B W H < S+ 0 0 88 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.787 133.0 30.4 -90.7 -30.1 74.3 51.5 53.9 162 148 B F >< + 0 0 41 -4,-2.2 3,-2.0 -5,-0.4 -1,-0.2 -0.445 61.1 156.4-131.8 59.0 77.8 50.6 52.6 163 149 B P T 3 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.655 72.8 61.7 -64.1 -16.8 79.8 49.4 55.7 164 150 B G T 3 S+ 0 0 72 -3,-0.1 2,-0.2 4,-0.0 -5,-0.1 0.420 73.0 126.1 -85.9 -0.6 82.2 47.5 53.4 165 151 B C <> - 0 0 4 -3,-2.0 4,-2.2 -7,-0.2 5,-0.1 -0.411 51.6-153.4 -65.3 126.6 83.4 50.5 51.5 166 152 B Q H > S+ 0 0 132 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.806 96.0 53.6 -72.3 -31.1 87.2 50.8 51.5 167 153 B F H > S+ 0 0 41 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.932 110.4 47.7 -65.0 -46.3 87.1 54.6 51.1 168 154 B L H >>S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.6 0.926 113.1 48.8 -56.1 -48.8 84.7 54.8 54.1 169 155 B L H X5S+ 0 0 73 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.931 113.0 45.6 -60.2 -48.7 87.1 52.5 56.1 170 156 B R H <5S+ 0 0 225 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.858 118.7 44.4 -62.3 -35.6 90.2 54.5 55.2 171 157 B S H <5S+ 0 0 54 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.865 132.7 11.8 -78.1 -40.2 88.4 57.8 56.0 172 158 B K H <5S- 0 0 84 -4,-2.9 4,-0.4 -5,-0.2 -3,-0.2 0.647 97.2-125.3-117.9 -23.7 86.6 57.0 59.3 173 159 B G X< - 0 0 27 -4,-1.9 4,-1.3 -5,-0.6 3,-0.1 0.022 31.1 -79.5 89.0 162.0 88.0 53.6 60.6 174 160 B Q H > S+ 0 0 93 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.840 122.6 59.0 -70.8 -36.4 86.2 50.4 61.6 175 161 B E H > S+ 0 0 168 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.906 104.1 52.6 -60.2 -42.8 85.0 51.5 65.1 176 162 B Y H > S+ 0 0 59 -4,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.923 113.0 44.2 -56.0 -47.0 83.0 54.4 63.5 177 163 B I H X S+ 0 0 2 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.944 114.5 48.2 -66.3 -49.8 81.3 52.0 61.1 178 164 B N H X S+ 0 0 81 -4,-3.0 4,-0.8 1,-0.2 3,-0.3 0.920 108.3 54.8 -57.5 -45.9 80.6 49.3 63.8 179 165 B N H >X S+ 0 0 91 -4,-2.9 4,-1.7 1,-0.2 3,-0.8 0.887 105.2 52.9 -57.9 -40.7 79.2 51.9 66.2 180 166 B I H 3< S+ 0 0 27 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.876 110.2 48.7 -62.7 -35.7 76.7 53.1 63.6 181 167 B H H 3< S+ 0 0 100 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.537 112.6 48.3 -81.8 -6.4 75.5 49.5 63.2 182 168 B L H << 0 0 143 -3,-0.8 -2,-0.2 -4,-0.8 -1,-0.2 0.645 360.0 360.0-100.2 -22.3 75.2 49.0 66.9 183 169 B T < 0 0 135 -4,-1.7 -3,-0.1 -5,-0.2 -2,-0.1 0.701 360.0 360.0 -96.5 360.0 73.2 52.2 67.6 184 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 185 1 Z X 0 0 24 0, 0.0 -129,-0.2 0, 0.0 -128,-0.1 0.000 360.0 360.0 360.0 159.1 85.0 60.6 15.2 186 2 Z X B C 55 0B 96 -131,-2.6 -131,-2.7 -116,-0.0 -129,-0.1 -0.977 360.0 360.0-136.4 151.4 82.0 61.6 13.1 187 3 Z P 0 0 83 0, 0.0 -133,-0.3 0, 0.0 -135,-0.0 -0.362 360.0 360.0 -63.3 360.0 79.1 64.1 13.6 188 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 189 1 Y X 0 0 24 0, 0.0 -42,-0.2 0, 0.0 -41,-0.1 0.000 360.0 360.0 360.0 149.5 68.6 58.6 52.8 190 2 Y X B F 146 0D 103 -44,-2.7 -44,-2.5 -29,-0.0 -42,-0.0 -0.961 360.0 360.0-139.0 155.4 67.6 55.3 51.1 191 3 Y P 0 0 94 0, 0.0 -46,-0.2 0, 0.0 -48,-0.0 -0.322 360.0 360.0 -59.5 360.0 69.0 53.1 48.2